Vitas-M small molecule compound

ethyl 4-({(Z)-[1-(3-methoxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)benzoate

Catalog ID
STL372445
SMILES CCOC(=O)c1ccc(cc1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H19N3O6 MW 409.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O6/c1-3-30-20(27)13-7-9-14(10-8-13)22-12-17-18(25)23-21(28)24(19(17)26)15-5-4-6-16(11-15)29-2/h4-12,22H,3H2,1-2H3,(H,23,25,28)/b17-12-
InChIKey
OWEBJHDRGJSNLC-ATVHPVEESA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)OC
CCOC(=O)c1ccc(cc1)NC=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)OC
ETHYL4(((Z)(1(3METHOXYPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)AMINO)BENZOATE
ethyl4(((Z)(1(3methoxyphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)amino)benzoate
InChI=1SC21H19N3O6c133020(27)137914(10813)22121718(25)2321(28)24(19(17)26)1554616(1115)292h41222H3H212H3(H232528)b1712
MFCD03711118
ZINC000003004046
ZINC03004046
ZINC3004046

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Available files

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